SCHEMBL21070262

SCHEMBL21070262

Nc1cccc2c1ccn2CCOCCOCC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 1/20 0.46
▸ MCL1 Q07820 5/20 0.42
▸ PPARG P37231 2/20 0.36
▸ PPARA Q07869 2/20 0.36
▸ BAD Q92934 1/20 0.36
▸ EGLN1 Q9GZT9 1/20 0.35
▸ HTR2C P28335 1/20 0.35
▸ LMNA P02545 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ DRD2 P14416 1/20 0.34
▸ HTR6 P50406 1/20 0.34
▸ HRH2 P25021 2/20 0.33
▸ CREBBP Q92793 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31664088 0.84 KDM4E (0.42) PARP1MCL1LMNACREBBP
SCHEMBL21070695 0.84 KDM4E (0.42) PARP1MCL1LMNACREBBP
SCHEMBL21071403 0.84 PARP1 (0.41) PARP1MCL1BADLMNASMN1; SMN2
SCHEMBL21069477 0.81 MCL1 (0.39) MCL1BADLMNAMEN1KMT2A
SCHEMBL31310600 0.81 MCL1 (0.39) MCL1BADLMNAMEN1KMT2A
SCHEMBL21070166 0.81 MCL1 (0.39) MCL1BADLMNAMEN1KMT2A
SCHEMBL31664174 0.81 MCL1 (0.39) MCL1BADLMNAMEN1KMT2A
SCHEMBL14671387 0.80 HTR2C (0.38) PARP1MCL1HTR2CLMNAMEN1
SCHEMBL27611518 0.77 PARP1 (0.43) PARP1MCL1BADHTR2CLMNA
SCHEMBL21070443 0.77 LMNA (0.58) LMNASMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230398223-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-12-14 — — US disclosed
US-11723980-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-08-15 — — US disclosed
US-20230106066-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-04-06 — — US disclosed
US-10874743-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2020-12-29 — — US disclosed
US-20190192668-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2019-06-27 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10874743-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 PARP1 85/4885MCL1 1117/4885PPARG 3050/4885
US-20230106066-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 PARP1 85/4885MCL1 1117/4885PPARG 3050/4885
US-11723980-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 PARP1 85/4885MCL1 1117/4885PPARG 3050/4885
US-20230398223-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 PARP1 85/4885MCL1 1117/4885PPARG 3050/4885
US-20190192668-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 PARP1 85/4885MCL1 1117/4885PPARG 3050/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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